4-[(7-methylsulfonyl-2,7-diazaspiro[3.5]nonan-2-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(7-methylsulfonyl-2,7-diazaspiro[3.5]nonan-2-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(7-methylsulfonyl-2,7-diazaspiro[3.5]nonan-2-yl)methyl]benzonitrile CAS Name: 4-[(7-methylsulfonyl-2,7-diazaspiro[3.5]nonan-2-yl)methyl]benzonitrile IUPAC Name: 4-[(7-methylsulfonyl-2,7-diazaspiro[3.5]nonan-2-yl)methyl]benzonitrile Traditional Name: 4-[(7-mesyl-2,7-diazaspiro[3.5]nonan-2-yl)methyl]benzonitrile Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2(CC1)CN(C2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CS(=O)(=O)N1CCC2(CC1)CN(C2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H21N3O2S/c1-22(20,21)19-8-6-16(7-9-19)12-18(13-16)11-15-4-2-14(10-17)3-5-15/h2-5H,6-9,11-13H2,1H3